| SpectraBase Compound ID | 7ht46sxXA39 |
|---|---|
| InChI | InChI=1S/C30H47N3O5S/c1-22-10-11-26-27(9-6-15-29(26,2)3)30(22,4)16-12-23(20-38-39(35,36)37)7-5-8-24-13-17-33(28(24)34)18-14-25-19-31-21-32-25/h9,13,19,21-23,26H,5-8,10-12,14-18,20H2,1-4H3,(H,31,32)(H,35,36,37)/t22-,23?,26-,30-/m0/s1 |
| InChIKey | IAJOBCOCHZRJMA-CYPSKNEPSA-N |
| Mol Weight | 561.8 g/mol |
| Molecular Formula | C30H47N3O5S |
| Exact Mass | 561.323643 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2v0EabHLIc9 |
|---|---|
| Name | IAJOBCOCHZRJMA-CYPSKNEPSA-N |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H47N3O5S |
| InChI | InChI=1S/C30H47N3O5S/c1-22-10-11-26-27(9-6-15-29(26,2)3)30(22,4)16-12-23(20-38-39(35,36)37)7-5-8-24-13-17-33(28(24)34)18-14-25-19-31-21-32-25/h9,13,19,21-23,26H,5-8,10-12,14-18,20H2,1-4H3,(H,31,32)(H,35,36,37)/t22-,23?,26-,30-/m0/s1 |
| InChIKey | IAJOBCOCHZRJMA-CYPSKNEPSA-N |
| Literature Reference Author | G.YAO,T.P.KONDRATYUK,G.T.TAN,J.M.PEZZUTO,L.C.CHANG |
| Literature Reference Citation | J.NAT.PROD.,72,319(2009) |
| Literature Reference DOI | 10.1021/np8005343 |
| Molecular Weight | 561.780 g/mol |
| Sample ID | 32237 |
| Solvent | CD3OD |